N-(2,6-dimethylphenyl)-2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[3-(2-hydroxyphenyl)-1-oxopropyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)CCC3=CC=CC=C3O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)CCC3=CC=CC=C3O

InChI

InChI=1S/C23H29N3O3/c1-17-6-5-7-18(2)23(17)24-21(28)16-25-12-14-26(15-13-25)22(29)11-10-19-8-3-4-9-20(19)27/h3-9,27H,10-16H2,1-2H3,(H,24,28)/p+1